N-[2-[methyl(2-phenylethyl)amino]propyl]-n-phenylpropanamide (CED0279181)

Record Information

Version

1.0

Creation Date

2026-08-30 08:32:39 UTC

Update Date

2026-08-30 08:32:39 UTC

Accession Number

CHEM324490

Identification

Common Name

N-[2-[methyl(2-phenylethyl)amino]propyl]-n-phenylpropanamide

Class

Small Molecule

Description

N-[2-[methyl(2-phenylethyl)amino]propyl]-n-phenylpropanamide is a chemical compound with the formula C21H28N2O and an average molecular weight of 324.50 g/mol. This substance has been identified in or released from one recorded source: electrical and electronic equipment, specifically electric switches.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₂₁H₂₈N₂O

Average Molecular Mass

Not Available

Monoisotopic Mass

324.220 g/mol

CAS Registry Number

552-25-0

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

CCC(=O)N(CC(C)N(C)CCC1=CC=CC=C1)C2=CC=CC=C2

InChI Identifier

InChI=1S/C21H28N2O/c1-4-21(24)23(20-13-9-6-10-14-20)17-18(2)22(3)16-15-19-11-7-5-8-12-19/h5-14,18H,4,15-17H2,1-3H3

InChI Key

RXTHKWVSXOIHJS-UHFFFAOYSA-N

Chemical Taxonomy

Classification

Not classified

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Not Available

Spectra

Spectrum Type	Description	Splash Key	Deposition Date	View
Predicted GC-MS	Predicted GC-MS Spectrum	splash10-03fr-4920000000-bb8391c2f318c448c7a5	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-004i-1927000000-6fb7bb3291448dfda8e5	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0a7l-2900000000-2878d934c9d37c115ccf	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0ab9-6900000000-2c1fc8d565b4a58ae9dc	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-00di-0019000000-0a5fb93f366c2ea25ee7	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-01ba-3985000000-76531aa5fca901554ed9	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0006-9700000000-f9ca4e37d2e027d805cd	Not Available	View Spectrum

Toxicity Profile

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Toxicity Values

Toxicity Value	Unit	Value Range	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Reference
724.0	Log mg/kg	[410:1300]	Rat	LD50	oral	predicted	Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
517	Electric Switches	Electrical & Electronic Equipment	Not Available

Pathways

0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q60492	Cavia porcellus	Predicted (SEA)	52.0811
Click to view 3D structure	Mu-type opioid receptor	P33535	Rattus norvegicus	Predicted (SEA)	158.735
Click to view 3D structure	Mu-type opioid receptor	P35372	Humans	Predicted (SEA)	198.438
Click to view 3D structure	Delta-type opioid receptor	P41143	Humans	Predicted (SEA)	282.126
Click to view 3D structure	Kappa-type opioid receptor	P41145	Humans	Predicted (SEA)	302.756
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q99720	Humans	Predicted (SEA)	316.379
Click to view 3D structure	Leukotriene B4 receptor 2	Q9JJL9	Mus musculus	Predicted (SEA)	6.69503
Click to view 3D structure	E3 ubiquitin-protein ligase RNF4	P78317	Humans	Predicted (SEA)	10.0426
Click to view 3D structure	D(3) dopamine receptor	P35462	Humans	Predicted (SEA)	460.79
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q9R0C9	Rattus norvegicus	Predicted (SEA)	149.159
Click to view 3D structure	Protein RecA	P9WHJ3	Mycobacterium tuberculosis	Predicted (SEA)	66.2497
Click to view 3D structure	ATP-dependent translocase ABCB1	P08183	Humans	Predicted (SEA)	125.804
Click to view 3D structure	Voltage-gated inwardly rectifying potassium channel KCNH2	Q12809	Humans	Predicted (SEA)	1166.03
Click to view 3D structure	Protein-glutamine gamma-glutamyltransferase	Q7M0F8	Cavia porcellus	Predicted (SEA)	4.67095
Click to view 3D structure	Kappa-type opioid receptor	P41144	Cavia porcellus	Predicted (SEA)	301.121
Click to view 3D structure	GIM-1 protein	Q704V1	Pseudomonas aeruginosa	Predicted (SEA)	5.60514
Click to view 3D structure	Mu-type opioid receptor	P97266	Cavia porcellus	Predicted (SEA)	331.56
Click to view 3D structure	Alpha-1A adrenergic receptor	P35348	Humans	Predicted (SEA)	341.836
Click to view 3D structure	D(1A) dopamine receptor	P21728	Humans	Predicted (SEA)	347.208
Click to view 3D structure	D(2) dopamine receptor	P14416	Humans	Predicted (SEA)	839.837
Click to view 3D structure	Glutamyl aminopeptidase	P16406	Mus musculus	Predicted (SEA)	9.57545
Click to view 3D structure	5-hydroxytryptamine receptor 1A	P19327	Rattus norvegicus	Predicted (SEA)	572.036
Click to view 3D structure	Trace amine-associated receptor 1	Q96RJ0	Humans	Predicted (SEA)	49.8235
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	583.947
Click to view 3D structure	Carbonic anhydrase 1	P00915	Humans	Predicted (SEA)	501.505